Geometry & MOs

Info

ID:	293130
PubChem CID:	117374485
Reduced:	OC8H12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-97.08
Dipole, Da:	2.17
IP(EA), eV:	-8.62(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[4-(1-methylazepan-4-yl)phenyl]ethanol

Drug info:

PubChemData

Smile

CC(C)(CO)C1=CC(=C(C=C1)OC)C2CCCC2

DOS

IR

Vibrations